Vitas-M small molecule compound
5-[1-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)propan-2-yl]-4-(2,4-dimethylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK307220
SMILES Cc1ccc(c(c1)C)n1c(S)nnc1C(Cn1nc(c(c1C)Br)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H22BrN5S MW 420.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22BrN5S/c1-10-6-7-15(11(2)8-10)24-17(20-21-18(24)25)12(3)9-23-14(5)16(19)13(4)22-23/h6-8,12H,9H2,1-5H3,(H,21,25)InChIKey
ROYGYEYQVFUMTL-UHFFFAOYSA-NSynonyms
1005683-44-21005683442
3(1(4BROMO35DIMETHYLPYRAZOL1YL)PROPAN2YL)4(24DIMETHYLPHENYL)1H124TRIAZOLE5THIONE
5(1(4bromo35dimethyl1Hpyrazol1yl)propan2yl)4(24dimethylphenyl)4H124triazole3thiol
5(2(4BROMO35DIMETHYL1HPYRAZOL1YL)1METHYLETHYL)4(24DIMETHYLPHENYL)24DIHYDRO3H124TRIAZOLE3THIONE
CC1=CC(=C(C=C1)N2C(=NNC2=S)C(C)CN3C(=C(C(=N3)C)Br)C)C
InChI=1SC18H22BrN5Sc1106715(11(2)810)2417(202118(24)25)12(3)92314(5)16(19)13(4)2223h6812H9H215H3(H2125)
MFCD04053658
ZINC000006626961
ZINC000006626966
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